Cas no 184954-60-7 (Carbamic acid, (trans-4-isothiocyanatocyclohexyl)-, 1,1-dimethylethylester)
184954-60-7 structure
Product Name:Carbamic acid, (trans-4-isothiocyanatocyclohexyl)-, 1,1-dimethylethylester
CAS No:184954-60-7
MF:C12H20N2O2S
MW:256.364401817322
CID:1378475
Update Time:2024-08-16
Carbamic acid, (trans-4-isothiocyanatocyclohexyl)-, 1,1-dimethylethylester Chemical and Physical Properties
Names and Identifiers
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- Carbamic acid, (trans-4-isothiocyanatocyclohexyl)-, 1,1-dimethylethylester
- Carbamic acid, (trans-4-isothiocyanatocyclohexyl)-, 1,1-dimethylethyl ester (9CI)
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- Inchi： 1S/C12H20N2O2S/c1-12(2,3)16-11(15)14-10-6-4-9(5-7-10)13-8-17/h9-10H,4-7H2,1-3H3,(H,14,15)/t9-,10-
- InChI Key： CFVYKEGQNIZMJB-MGCOHNPYSA-N
- SMILES： C(OC(C)(C)C)(=O)N[C@@H]1CC[C@@H](N=C=S)CC1
Computed Properties
- Exact Mass: 256.1247
Experimental Properties
- Density: 1.15±0.1 g/cm3(Predicted)
- Boiling Point: 389.0±22.0 °C(Predicted)
- PSA: 50.69
- pka: 12.18±0.40(Predicted)
Carbamic acid, (trans-4-isothiocyanatocyclohexyl)-, 1,1-dimethylethylester Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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